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DocumentationIdentifier: MM364639
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364639 |
| SMILES |
C#CC(=O)C=CCCC=C
|
| InChIKey |
VHNPKCIDJRMWTN-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
1.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170025
Similarity: 0.8933
Similarity to MM170025
| Tanimoto metric | 0.8933 |
|---|---|
| Cosine metric | 0.9452 |
| Dice metric | 0.9437 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364669
Similarity: 0.8272
Similarity to MM364669
| Tanimoto metric | 0.8272 |
|---|---|
| Cosine metric | 0.9055 |
| Dice metric | 0.9054 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364603
Similarity: 0.8072
Similarity to MM364603
| Tanimoto metric | 0.8072 |
|---|---|
| Cosine metric | 0.8933 |
| Dice metric | 0.8933 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+418 more
